COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK607417
Chemical Name: methyl2-{[4-cyano-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}butanoate
Smiles: CCC(C(=O)OC)Sc1nc(N2CCOCC2)c2c(c1C#N)CCCC2

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Molecular Weight: 375.49
Empirical Formula: C19H25N3O3S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.586
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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